2-[4-[(4-cyclopropyl-3-piperidin-1-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-[(4-cyclopropyl-3-piperidin-1-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-[[4-cyclopropyl-3-(1-piperidyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]piperazin-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[4-[[4-cyclopropyl-3-(1-piperidinyl)-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]-1-piperazinyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-[(4-cyclopropyl-3-piperidin-1-yl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[4-[(4-cyclopropyl-3-piperidino-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazino]-1-piperidino-ethanone Formula: C22H37N7OS MolecularWeight: 447.64048

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NN(C(=S)N2C3CC3)CN4CCN(CC4)CC(=O)N5CCCCC5

Isomeric SMILES

C1CCN(CC1)C2=NN(C(=S)N2C3CC3)CN4CCN(CC4)CC(=O)N5CCCCC5

InChI

InChI=1S/C22H37N7OS/c30-20(26-9-3-1-4-10-26)17-24-13-15-25(16-14-24)18-28-22(31)29(19-7-8-19)21(23-28)27-11-5-2-6-12-27/h19H,1-18H2